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CS-W001157 4
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3-Methylenepyrrolidin-2-one

  • CAS No. 76220-95-6

  • Cat. No. CS-0567707
  • Purity≥98%
  • MDL No.None

*For research and further manufacturing use only, not for direct human use.

3-Methylenepyrrolidin-2-one|CS-0567707

Structure of 76220-95-6

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General Information

  • CAS No. 76220-95-6
  • Cat. No. CS-0567707
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₅H₇NO
  • Molecular Weight 97.12
  • Synonym(s) 3-Methylene-2-pyrrolidinone
  • SMILES C=C1CCNC1=O

Synthesis

  • Route1

    References

    • Klutchko, Sylvester; Hoefle, Milton L.; Smith, Ronald D.; Essenburg, Arnold D.; Parker, Robert B.; et al. Journal of Medicinal Chemistry, 1981 , vol. 24, # 1 p. 104 - 109
  • Route2

    References

    • Klutchko, Sylvester; Hoefle, Milton L.; Smith, Ronald D.; Essenburg, Arnold D.; Parker, Robert B.; et al. Journal of Medicinal Chemistry, 1981 , vol. 24, # 1 p. 104 - 109
  • Route3
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      547-65-9
    • ~74%
    • 3-Methylenepyrrolidin-2-one|CS-0567707
      76220-95-6

    References

    • Hu, Bing C.; Zhou, Wei Y.; Liu, Zu L.; Cai, Chao J.; Xu, Shi C. Journal of Porphyrins and Phthalocyanines, 2010 , vol. 14, # 1 p. 89 - 100

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   29.1
  • LogP   0.0625
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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